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GROMACS Molecular Simulations at Scale

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Amber, NAMD, gromacs, moe




Purpose Built to Power Drug Discovery

Break free from your local license and compute limits with our turnkey and scalable GROMACS service.  Setup in (literally) second and submit to our cloud clusters at a push of a button.   Easily manage your drug discovery projects' unique timelines and budgets - on a pay-as-you-use basis.

Want to learn more?  Interested in a demo? Have questions? We look forward to meeting you over a virtual coffee.

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Scale as Needed

From protein dynamics to peptide modeling and everything in-between, run simulations at scale and concurrently. We provide the CPU and GPU powered machines and licenses needed - without impact to your local GROMACS md simulation resources. 

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Easy Setup and Submit

Easily set-up and launch molecular dynamics simulations in seconds. Use our easy-to-use submission GUI (see HERE) or command line interface to access thousands of high-performance servers running GROMACS. Results are automatically downloaded - no end-user management of machines, data, or licenses required. 

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Securely Built

Our cloud-based GROMACS molecular dynamics simulation service is built on the highly secure AWS and Oracle cloud infrastructures. Your submission is encrypted end-to-end. 

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All-Inclusive Pricing

No hidden costs for machines, data storage, data egress, simulations software and licensing. Scale and configure machines to fit your GROMACS molecular modeling project budget and timeline on a per-job basis with our hourly pricing option.   

antibody design,  biologics design, Chemical Computing Group, NuChem Sciences, cheminformatics, grid computing,  high performance cloud computing, computer aided molecular design, docking, drug discovery, GROMACS,peptide modeling, small molecules

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